ATOM 43
1 C2y C 19.6186 -17.9120
2 C2b C 18.3395 -18.4095
3 N1x N 19.6896 -16.4908
4 C2y C 20.9687 -18.4095
5 C2y C 17.0603 -17.9120
6 C5x C 21.0397 -16.2066
7 C2y C 21.7504 -17.3435
8 C2y C 15.7812 -18.5516
9 N2x N 16.7761 -16.5618
10 N4x N 16.7051 -13.5772
11 C2y C 14.7863 -17.6277
12 C2y C 15.4259 -16.3487
13 C5x C 21.0397 -13.7193
14 C8y C 16.9182 -12.2270
15 C8y C 15.3548 -13.7904
16 C2b C 14.9284 -15.1406
17 C2y C 21.6082 -12.4403
18 N1x N 19.6186 -13.5062
19 C8y C 15.6391 -11.6585
20 C2b C 18.1262 -11.5164
21 C8y C 14.7153 -12.5824
22 C2y C 20.6845 -11.5164
23 C2y C 19.4053 -12.1560
24 C2b C 15.6391 -10.2373
25 C1a C 13.2940 -12.5824
26 C1a C 20.6134 -10.0953
27 C2a C 16.8472 -9.5268
28 C2b C 23.0295 -12.2270
29 C2a C 23.9533 -13.3640
30 C1b C 20.8976 -19.9017
31 C1b C 22.1767 -20.6124
32 C6a C 22.1057 -22.1046
33 O6a O 23.3849 -22.8864
34 O6a O 20.8266 -22.8153
35 C1b C 15.7812 -19.9017
36 C1b C 14.5021 -20.5412
37 C6a C 14.5021 -21.8915
38 O6a O 13.2940 -22.5310
39 O6a O 15.6391 -22.6731
40 C1a C 13.3652 -17.6988
41 C1a C 23.1006 -17.4146
42 O5x O 22.2739 -14.4319
43 O5x O 22.2739 -15.4940
BOND 46
1 10 15 1
2 12 16 2
3 13 17 1
4 13 18 1
5 14 19 2
6 14 20 1
7 15 21 2
8 17 22 2
9 18 23 1
10 19 24 1
11 21 25 1
12 22 26 1
13 6 7 1
14 11 12 1
15 15 16 1
16 19 21 1
17 20 23 2
18 22 23 1
19 24 27 2
20 17 28 1
21 28 29 2
22 1 2 2
23 4 30 1
24 1 3 1
25 30 31 1
26 1 4 1
27 31 32 1
28 2 5 1
29 32 33 2
30 3 6 1
31 32 34 1
32 4 7 2
33 8 35 1
34 5 8 1
35 35 36 1
36 5 9 2
37 36 37 1
38 37 38 1
39 8 11 2
40 37 39 2
41 9 12 1
42 11 40 1
43 7 41 1
44 10 14 1
45 13 42 2
46 6 43 2
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